titanium; 2,3,4-tris(2-phenylpropan-2-yl)phenol

Systemtic Name: titanium; 2,3,4-tris(2-phenylpropan-2-yl)phenol Openeye Name: titanium; 2,3,4-tris(1-methyl-1-phenyl-ethyl)phenol CAS Name: titanium; 2,3,4-tris(2-phenylpropan-2-yl)phenol IUPAC Name: titanium; 2,3,4-tris(2-phenylpropan-2-yl)phenol Traditional Name: titanium; 2,3,4-tricumylphenol Formula: C132H144O4Ti MolecularWeight: 1842.42036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C2=C(C(=C(C=C2)O)C(C)(C)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4.CC(C)(C1=CC=CC=C1)C2=C(C(=C(C=C2)O)C(C)(C)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4.CC(C)(C1=CC=CC=C1)C2=C(C(=C(C=C2)O)C(C)(C)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4.CC(C)(C1=CC=CC=C1)C2=C(C(=C(C=C2)O)C(C)(C)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4.[Ti]

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C2=C(C(=C(C=C2)O)C(C)(C)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4.CC(C)(C1=CC=CC=C1)C2=C(C(=C(C=C2)O)C(C)(C)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4.CC(C)(C1=CC=CC=C1)C2=C(C(=C(C=C2)O)C(C)(C)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4.CC(C)(C1=CC=CC=C1)C2=C(C(=C(C=C2)O)C(C)(C)C3=CC=CC=C3)C(C)(C)C4=CC=CC=C4.[Ti]

InChI

InChI=1S/4C33H36O.Ti/c4*1-31(2,24-16-10-7-11-17-24)27-22-23-28(34)30(33(5,6)26-20-14-9-15-21-26)29(27)32(3,4)25-18-12-8-13-19-25;/h4*7-23,34H,1-6H3;